Compound Identification
SMILES
CCCCCCCCNC1=C(C=C(Cl)C=C1)C(=O)NC(CC1=CC=C(C=C1)C1=CC=CC=C1OC1=CC=CC=C1)C(O)=O
InChIKey
InChIKey=LOWZMTBKMIXZNJ-UHFFFAOYSA-N
Formula
C36H39ClN2O4
Mass
599.17
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Phenylalanine and derivatives
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Level 6
Alpha amino acids and derivatives
-
Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Phenylalanine and derivatives
Alternative Parents
Diphenylethers Hippuric acids N-acyl-alpha amino acids Biphenyls and derivatives Phenylpropanoic acids Diarylethers 2-aminobenzamides 3-halobenzoic acids and derivatives Amphetamines and derivatives Anthranilamides Phenylalkylamines Phenoxy compounds Aniline and substituted anilines Benzoyl derivatives Phenol ethers Chlorobenzenes Secondary alkylarylamines Aryl chlorides Vinylogous amides Amino acids Secondary carboxylic acid amides Carboxylic acids Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylalanine or derivatives - Hippuric acid or derivatives - Hippuric acid - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Diphenylether - Biphenyl - Diaryl ether - 3-phenylpropanoic-acid - Aminobenzamide - Anthranilamide - Aminobenzoic acid or derivatives - Amphetamine or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 2-aminobenzamide - Benzamide - Benzoic acid or derivatives - Phenylalkylamine - Aniline or substituted anilines - Benzoyl - Phenol ether - Phenoxy compound - Secondary aliphatic/aromatic amine - Chlorobenzene - Halobenzene - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Vinylogous amide - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Secondary amine - Ether - Monocarboxylic acid or derivatives - Carboxylic acid - Amine - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available